{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9551252 -2.5848975 1.6814654 ] [ -3.1314106 -0.3788398 2.8433329 ] [ 0.6312564 0.1118301 0.7258703 ] [ 1.1729654 3.5567169 -1.9971984 ] [ -0.6279364 -0.7048097 -3.2534702 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.132455886176924e-09 -4.141462341664368e-09 2.694004552564121e-09 ] [ -5.017072853445301e-09 -6.069682705885479e-10 4.555521497531465e-09 ] [ 1.011384245810373e-09 1.791715717217261e-10 1.162972424393082e-09 ] [ 1.879297740887321e-09 5.698488663984252e-09 -3.199864583579167e-09 ] [ -1.006065019429317e-09 -1.129229623453062e-09 -5.2126338909095e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.175393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.751801311765198e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2606238 2.3147621 1.63064 ] [ 2.6155005 0.5399922 2.3775711 ] [ 2.5797548 4.2537326 1.4215906 ] [ 3.5094027 2.1514506 0.9121124 ] [ 3.0228581 2.7243762 3.1559892 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2606238e-10 2.3147621e-10 1.63064e-10 ] [ 2.6155005e-10 5.399922e-11 2.3775711e-10 ] [ 2.5797548e-10 4.2537326e-10 1.4215906e-10 ] [ 3.5094027e-10 2.1514506e-10 9.121124e-11 ] [ 3.0228581e-10 2.7243762e-10 3.1559892e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.08e-05 9.5e-06 -2.17e-05 ] [ 1.9e-05 -1.1e-05 -1.46e-05 ] [ -1.05e-05 3.09e-05 -3.6e-06 ] [ -6.6e-06 -3.99e-05 8.9e-06 ] [ 1.9e-05 1.06e-05 3.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.332527371264e-14 1.52206778976e-14 -3.476723267136e-14 ] [ 3.04413557952e-14 -1.76239428288e-14 -2.339177866368e-14 ] [ -1.68228545184e-14 4.950725758272e-14 -5.76783583488e-15 ] [ -1.057436569728e-14 -6.392684716992e-14 1.425937192512e-14 ] [ 3.04413557952e-14 1.698307218048e-14 4.982769290688e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }